6-Quinolinecarboxylicacid,3-chloro-2-(3,4-dimethyl-3-penten-1-yl)-1,2,3,4-tetrahydro-2-(methoxymethyl)-,(2R,3R)-

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Names

[ CAS No. ]:
76417-04-4

[ Name ]:
6-Quinolinecarboxylicacid,3-chloro-2-(3,4-dimethyl-3-penten-1-yl)-1,2,3,4-tetrahydro-2-(methoxymethyl)-,(2R,3R)-

[Synonym ]:
(-)-virantmycin
6-Quinolinecarboxylic acid,3-chloro-2-(3,4-dimethyl-3-pentenyl)-1,2,3,4-tetrahydro-2-(methoxymethyl)
6-Quinolinecarboxylic acid,1,2,3,4-tetrahydro-3-chloro-2-(3,4-dimethyl-3-pentenyl)-2-(methoxymethyl)-,(2S-trans)

Chemical & Physical Properties

[ Molecular Formula ]:
C19H26ClNO3

[ Molecular Weight ]:
351.86800

[ Exact Mass ]:
351.16000

[ PSA ]:
58.56000

[ LogP ]:
4.61990

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ZA4826100
CHEMICAL NAME :
6-Quinolinecarboxylic acid, 1,2,3,4-tetrahydro-3-chloro-2-(3,4-dimethyl-3-penteny l)- 2-(methoxymethyl)-, (2S-trans)-
CAS REGISTRY NUMBER :
76417-04-4
LAST UPDATED :
199307
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C19-H26-Cl-N-O3
MOLECULAR WEIGHT :
351.91

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
5 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JANTAJ Journal of Antibiotics. (Japan Antibiotics Research Assoc., 2-20-8 Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan) V.2-5, 1948-52; V.21- 1968- Volume(issue)/page/year: 33,1395,1980

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • carbon monoxide
  • (2R,3R)-3-chloro-2-(3,4-dimethylpent-3-enyl)-6-iodo-2-methoxymethyl-1,2,3,4-tetrahydroquinoline
  • tert-butyl (2S)-5-iodo-2-(methoxyacetyl)indoline-1-carboxylate
  • (2R)-2-[(2S)-2,3-dihydro-5-iodo-1H-indol-2-yl]-1-methoxy-5,6-dimethylhept-5-en-2-ol
  • tert-butyl (2S)-2-[(1R)-1-hydroxy-1-methoxymethyl-4,5-dimethylhex-4-enyl]-5-iodoindoline-1-carboxylate
  • (2S)-2-Indolinecarboxylic acid
  • 1H-Indole-2-carboxylicacid,2,3-dihydro-,methylester,(2S)-(9CI)
  • methyl (S)-N-(tert-butoxycarbonyl)indoline-2-carboxylate
  • tert-butyl (2S)-2-{[methoxy(methyl)amino]carbonyl}indoline-1-carboxylate

DownStream

Related Compounds

  • Ethyl 8-chloro-6-quinolinecarboxylate
  • Ethyl 3-acetyl-4-hydroxyquinoline-6-carboxylate
  • 6-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, Methyl ester
  • N'-[(E)-1H-Indol-3-ylmethylene]-6-quinolinecarbohydrazide
  • ethyl 8-cyano-2-methyl-5-oxo-1H-quinoline-6-carboxylate
  • ethyl 1-oxidoquinolin-1-ium-6-carboxylate
  • (3E)-3-[hydroxy(phenyl)methylidene]-2,4-dioxo-1H-quinoline-6-carboxylic acid
  • Ethyl 3-amino-5-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]thieno[2,3-b]pyridine-2-carboxylate
  • 1-(Bromomethyl)-1-(isopropoxymethyl)cyclopentane
  • 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-[(dimethylamino)methylidene]-2,2-difluoroacetamide
  • 2-{[1-(bromomethyl)cyclopentyl]methyl}-2,3-dihydro-1H-isoindole-1,3-dione
  • 3-chloro-2-(difluoro(1-(4-nitrophenyl)-1H-1,2,4-triazol-5-yl)methyl)-5-(trifluoromethyl)pyridine
  • 1-Cyclopropyl-2-methylpiperidin-4-amine
  • Methyl 3-chloro-1'-methyl-6'-oxo-5-(trifluoromethyl)-1',6'-dihydro-[2,3'-bipyridine]-5'-carboxylate
  • (2-Bromo-1-(3,3-dimethylbutoxy)ethyl)benzene
  • 5-Chloro-3-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
  • 1-Bromo-2-(3,3-dimethylbutoxy)cycloheptane
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